Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAGLA | Q9Y4D2 | 8/20 | 0.67 |
| ▸ | FAAH | O00519 | 7/20 | 0.45 |
| ▸ | CES1 | P23141 | 2/20 | 0.45 |
| ▸ | XDH | P47989 | 2/20 | 0.44 |
| ▸ | TLR4 | O00206 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.39 |
| ▸ | GABRP | O00591 | 1/20 | 0.38 |
| ▸ | GABRD | O14764 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL4048199 | 0.81 | DAGLA (0.60) | DAGLAFAAHCES1XDHHDAC3 | |
| SCHEMBL4046625 | 0.80 | DAGLA (0.62) | DAGLAFAAHCES1HDAC3HDAC4 | |
| SCHEMBL4051507 | 0.80 | DAGLA (0.67) | DAGLAFAAHCES1XDH | |
| SCHEMBL4050551 | 0.78 | DAGLA (0.57) | DAGLAFAAHCES1XDHHDAC3 | |
| SCHEMBL3640199 | 0.76 | DAGLA (0.56) | DAGLAXDHHDAC6GABRPGABRD | |
| SCHEMBL6982900 | 0.76 | DAGLA (0.54) | DAGLAXDHHDAC3HDAC4HDAC1 | |
| SCHEMBL6976559 | 0.75 | DAGLA (0.52) | DAGLAXDHHDAC6GABRPGABRD | |
| SCHEMBL12469642 | 0.72 | DAGLA (0.46) | DAGLAXDHTLR4HDAC6GABRP | |
| SCHEMBL14110414 | 0.71 | DAGLA (0.52) | DAGLAXDHGABRPGABRDGABRA1 | |
| SCHEMBL14110503 | 0.71 | DAGLA (0.62) | DAGLAFAAHCES1XDH |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1744755-B1 | COMPOUNDS AND COMPOSITIONS AS CATHEPSIN S INHIBITORS | IRM LLC (BM) | 2012-12-05 | — | — | EP | claimed |